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P-606142596

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Name File
SDF P-606142596.sdf
SMILES P-606142596.smiles
Standard InChI P-606142596.inchi
InChIKey P-606142596.txt
Property Value
Components 1
Mass 218.294
logP 3.0635
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 4
PSA 41.99
RO5 violations 0
RO3 violations 2
Refractivity 65.2777
Atoms 34
Rings 2
Heavy atoms 16
Hydrogen atoms 18
Heteroatoms 3
N/O atoms 3
Inorganic atoms 0
Halogen atoms 0
Chiral centers 0
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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